pyrazine-2,5-diamine dihydrochloride

• ChemBase ID: 293310
• Molecular Formular: C4H8Cl2N4
• Molecular Mass: 183.03912
• Monoisotopic Mass: 182.01260164
• SMILES: Nc1ncc(N)nc1.Cl.Cl
• Canonical SMILES: Nc1ncc(nc1)N.Cl.Cl
• InChI: InChI=1S/C4H6N4.2ClH/c5-3-1-7-4(6)2-8-3;;/h1-2H,(H2,6,7)(H2,5,8);2*1H
• InChIKey: GYKJUORFNIUYGA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: pyrazine-2,5-diamine dihydrochloride
• IUPAC Traditional name: pyrazine-2,5-diamine dihydrochloride
• Synonyms: Pyrazine-2,5-diamine dihydrochloride

Database IDs

• PubChem SID: 180678841
• PubChem CID: 71720969

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -0.9315417
• LogD (pH = 7.4): -0.93104225
• Log P: -0.9310359
• Molar Refractivity: 31.772 cm^3
• Polarizability: 10.841375 Å^3
• Polar Surface Area: 77.82 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%